(2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide

C15H24N2O — CID 7044016

IUPAC(2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide
SMILESCCN(CC)[C@@H](C)C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C15H24N2O/c1-6-17(7-2)13(5)15(18)16-14-11(3)9-8-10-12(14)4/h8-10,13H,6-7H2,1-5H3,(H,16,18)/t13-/m0/s1
InChIKeyMAODNVTZUXOBNL-ZDUSSCGKSA-N
MW248.37 g/mol
LogP2.97
Rot. Bonds5

About (2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide

(2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide (PubChem CID 7044016) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is (2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide
PubChem CID7044016
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name(2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide
SMILESCCN(CC)[C@@H](C)C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C15H24N2O/c1-6-17(7-2)13(5)15(18)16-14-11(3)9-8-10-12(14)4/h8-10,13H,6-7H2,1-5H3,(H,16,18)/t13-/m0/s1
InChIKeyMAODNVTZUXOBNL-ZDUSSCGKSA-N
XLogP2.97
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(diethylamino)-N-(2,6-dimethylphenyl)pentanamide
CID 3048765
N-(2,6-dimethylphenyl)-2-[hydroxymethyl(1-hydroxypropan-2-yl)amino]propanamide
CID 20978214
N-(2,6-dimethylphenyl)-2-methylpropanamide;yttrium
CID 158388394
N-(2,6-dimethylphenyl)-2-methylpentanamide
CID 2890749
2-(diethylamino)-N-(4-methylphenyl)propanamide
CID 24843836
N-(3-amino-2-methylphenyl)-2-(diethylamino)propanamide
CID 16779035
2-[butyl(ethyl)amino]-N-(2,6-dimethylphenyl)butanamide;ethane
CID 145255020
N-(2,6-dimethylphenyl)-2-[ethyl(propyl)amino]butanamide;methanesulfonic acid
CID 75989741
(2S)-2-[[4-(dimethylamino)phenyl]methyl-ethylamino]-N-[2-(2,6-dimethylanilino)-2-oxoethyl]propanamide
CID 9030363
2-amino-N-(2,6-dimethylphenyl)butanamide;hydrochloride
CID 12546861
2-(diethylamino)-N-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)propanamide;hydrochloride
CID 3069966
(2S)-N-(2,6-dimethylphenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]propanamide
CID 9494913

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide?
The IUPAC name of (2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide (CID 7044016) is (2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide.
What is the SMILES notation for (2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide?
The canonical SMILES for (2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide is CCN(CC)[C@@H](C)C(=O)Nc1c(C)cccc1C.
What is the InChIKey of (2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide?
The InChIKey is MAODNVTZUXOBNL-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H24N2O/c1-6-17(7-2)13(5)15(18)16-14-11(3)9-8-10-12(14)4/h8-10,13H,6-7H2,1-5H3,(H,16,18)/t13-/m0/s1.
What are the key properties of (2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide?
(2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide has a molecular weight of 248.37 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide is sourced from PubChem (CID 7044016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).